Valdivia, Abel Cardenas; Dai, Yasi; Rambaldi, Filippo; Barker, Joshua E; Dressler, Justin J; Zhou, Zheng; Zhu, Yikun; Wei, Zheng; Petrukhina, Marina A; Haley, Michael M; Negri, Fabrizia; Casado, Juan, Orbital Nature of Carboionic Monoradicals Made from Diradicals, «CHEMISTRY-A EUROPEAN JOURNAL», 2023, 29, Article number: e202300388, pp. 1 - 10 [articolo]Open Access
Robert Herzhoff, Fabrizia Negri, Klaus Meerholz, Daniele Fazzi, Revealing the interplay between the structural complexity of triphenylamine redox derivatives and their charge transport processes via computational modeling, «JOURNAL OF MATERIALS CHEMISTRY. C», 2023, 11, pp. 11969 - 11979 [articolo]Open Access
Mesto, D; Dai, Y; Dibenedetto, CN; Punzi, A; Krajcovic, J; Striccoli, M; Negri, F; Blasi, D, Tuning the Electro-Optical Properties of Mixed-Halide Trityl Radicals Bearing para-Brominated Positions through Halogen Substitution, «EUROPEAN JOURNAL OF ORGANIC CHEMISTRY», 2023, 26, Article number: e202201030, pp. 1 - 8 [articolo]Open Access
Ji Y.; Moles Quintero S.; Dai Y.; Marín-Beloqui J.M.; Zhang H.; Zhan Q.; Sun F.; Wang D.; Li X.; Wang Z.; Gu X.; Negri F.; Casado J.; Zheng Y., 77 % Photothermal Conversion in Blatter-Type Diradicals: Photophysics and Photodynamic Applications, «ANGEWANDTE CHEMIE. INTERNATIONAL EDITION», 2023, 62, Article number: e202311387, pp. 1 - 8 [articolo]Open Access
Bassan, Elena; Dai, Yasi; Fazzi, Daniele; Gualandi, Andrea; Cozzi, Pier Giorgio; Negri, Fabrizia; Ceroni, Paola, Effect of the iodine atom position on the phosphorescence of BODIPY derivatives: a combined computational and experimental study, «PHOTOCHEMICAL & PHOTOBIOLOGICAL SCIENCES», 2022, 21, pp. 777 - 786 [articolo]Open Access
Dai Y.; Zubiria-Ulacia M.; Casanova D.; Negri F., Impact of Charge-Resonance Excitations on CT-Mediated J-Type Aggregation in Singlet and Triplet Exciton States of Perylene Di-Imide Aggregates: A TDDFT Investigation, «COMPUTATION», 2022, 10, Article number: 18, pp. 1 - 13 [articolo]Open Access
Mori, Sakura; Moles Quintero, Sergio; Tabaka, Naoki; Kishi, Ryohei; González Núñez, Raúl; Harbuzaru, Alexandra; Ponce Ortiz, Rocío; Marín-Beloqui, Jose; Suzuki, Shuichi; Kitamura, Chitoshi; Gómez-García, Carlos J; Dai, Yasi; Negri, Fabrizia; Nakano, Masayoshi; Kato, Shin-Ichiro; Casado, Juan, Medium Diradical Character, Small Hole and Electron Reorganization Energies and Ambipolar Transistors in Difluorenoheteroles, «ANGEWANDTE CHEMIE. INTERNATIONAL EDITION», 2022, 61, Article number: e202206680, pp. 1 - 8 [articolo]Open Access
Yasi Dai; Laura Bonometti; José Luis Zafra; Kazuo Takimiya; Juan Casado; Fabrizia Negri, Raman Activities of Cyano-Ester Quinoidal Oligothiophenes Reveal Their Diradical Character and the Proximity of the Low-Lying Double Exciton State, «CHEMISTRY», 2022, 4, pp. 329 - 344 [articolo]Open Access
Salvitti, Giovanna; Pizzano, Emanuele; Baroncelli, Filippo; Melandri, Sonia; Evangelisti, Luca; Negri, Fabrizia; Coreno, Marcello; Prince, Kevin C; Ciavardini, Alessandra; Sa'adeh, Hanan; Pori, Matteo; Mazzacurati, Marzia; Maris, Assimo, Spectroscopic and quantum mechanical study of a scavenger molecule: N,N-diethylhydroxylamine, «SPECTROCHIMICA ACTA. PART A, MOLECULAR AND BIOMOLECULAR SPECTROSCOPY», 2022, 281, Article number: 121555, pp. 1 - 13 [articolo]Open Access
Badía-Domínguez, Irene; Canola, Sofia; Hernández Jolín, Víctor; López Navarrete, Juan T; Sancho-García, Juan C; Negri, Fabrizia; Ruiz Delgado, M Carmen, Tuning the Diradical Character of Indolocarbazoles: Impact of Structural Isomerism and Substitution Position, «THE JOURNAL OF PHYSICAL CHEMISTRY LETTERS», 2022, 13, pp. 6003 - 6010 [articolo]Open Access
Evangelisti, Luca; Melandri, Sonia; Negri, Fabrizia; Coreno, Marcello; Prince, Kevin C.; Maris, Assimo, UPS, XPS, NEXAFS and Computational Investigation of Acrylamide Monomer, «PHOTOCHEM», 2022, 2, pp. 463 - 478 [articolo]Open Access
Fazzi D.; Negri F., Addressing the Elusive Polaronic Nature of Multiple Redox States in a π-Conjugated Ladder-Type Polymer, «ADVANCED ELECTRONIC MATERIALS», 2021, 7, Article number: 2000786, pp. 1 - 11 [articolo]Open Access
Canola S.; Bagnara G.; Dai Y.; Ricci G.; Calzolari A.; Negri F., Addressing the Frenkel and charge transfer character of exciton states with a model Hamiltonian based on dimer calculations: Application to large aggregates of perylene bisimide, «THE JOURNAL OF CHEMICAL PHYSICS», 2021, 154, Article number: 124101, pp. 1 - 13 [articolo]Open Access
Ricci G.; Canola S.; Dai Y.; Fazzi D.; Negri F., Impact of fluoroalkylation on the n-type charge transport of two naphthodithiophene diimide derivatives, «MOLECULES», 2021, 26, Article number: 4119, pp. 1 - 17 [articolo]Open Access
Shen Y.; Xue G.; Dai Y.; Quintero S.M.; Chen H.; Wang D.; Miao F.; Negri F.; Zheng Y.; Casado J., Normal & reversed spin mobility in a diradical by electron-vibration coupling, «NATURE COMMUNICATIONS», 2021, 12, Article number: 6262, pp. 1 - 8 [articolo]Open Access
